N-[1-(4-tert-butylphenyl)ethyl]-4-(phenylsulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-[1-(4-tert-butylphenyl)ethyl]-4-(phenylsulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-(benzenesulfonyl)-N-[1-(4-tert-butylphenyl)ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-(benzenesulfonyl)-N-[1-(4-tert-butylphenyl)ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-(benzenesulfonyl)-N-[1-(4-tert-butylphenyl)ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-besyl-N-[1-(4-tert-butylphenyl)ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C27H30N2O4S MolecularWeight: 478.6031

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(C)(C)C)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=C(C=C1)C(C)(C)C)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H30N2O4S/c1-19(20-14-16-21(17-15-20)27(2,3)4)28-26(30)25-18-29(23-12-8-9-13-24(23)33-25)34(31,32)22-10-6-5-7-11-22/h5-17,19,25H,18H2,1-4H3,(H,28,30)